Vitas-M small molecule compound
4-(4-methoxyphenyl)-7,7-dimethyl-1-[(naphthalen-1-ylmethyl)sulfanyl]-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK722771
SMILES COc1ccc(cc1)n1c2nnc(n2c2c(c1=O)c1CC(C)(C)OCc1s2)SCc1cccc2c1cccc2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C30H26N4O3S2 MW 554.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26N4O3S2/c1-30(2)15-23-24(16-37-30)39-27-25(23)26(35)33(20-11-13-21(36-3)14-12-20)28-31-32-29(34(27)28)38-17-19-9-6-8-18-7-4-5-10-22(18)19/h4-14H,15-17H2,1-3H3InChIKey
YOBPRGWAQOJCJH-UHFFFAOYSA-NSynonyms
4(4methoxyphenyl)77dimethyl1((naphthalen1ylmethyl)sulfanyl)69dihydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
4(4methoxyphenyl)77dimethyl1((naphthalen1ylmethyl)thio)67dihydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(9H)one
CC1(CC2=C(CO1)SC3=C2C(=O)N(C4=NN=C(N34)SCC5=CC=CC6=CC=CC=C65)C7=CC=C(C=C7)OC)C
InChI=1SC30H26N4O3S2c130(2)152324(163730)392725(23)26(35)33(20111321(363)141220)28313229(34(27)28)381719968187451022(18)19h414H1517H213H3
MFCD02240375
ZINC000002587127
ZINC02587127
ZINC2587127
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